1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine

C18H21FN2 — CID 1377218

IUPAC1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine
SMILESCc1ccccc1N1CCN(Cc2ccc(F)cc2)CC1
InChIInChI=1S/C18H21FN2/c1-15-4-2-3-5-18(15)21-12-10-20(11-13-21)14-16-6-8-17(19)9-7-16/h2-9H,10-14H2,1H3
InChIKeyBYBZNLJGXMTDGD-UHFFFAOYSA-N
MW284.38 g/mol
LogP3.46
Rot. Bonds3

About 1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine

1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine (PubChem CID 1377218) has the molecular formula C18H21FN2 and a molecular weight of 284.38 g/mol. Its IUPAC name is 1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine.

Molecular Properties

Compound Name1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine
PubChem CID1377218
Molecular FormulaC18H21FN2
Molecular Weight284.38 g/mol
Exact Mass284.17
IUPAC Name1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine
SMILESCc1ccccc1N1CCN(Cc2ccc(F)cc2)CC1
InChIInChI=1S/C18H21FN2/c1-15-4-2-3-5-18(15)21-12-10-20(11-13-21)14-16-6-8-17(19)9-7-16/h2-9H,10-14H2,1H3
InChIKeyBYBZNLJGXMTDGD-UHFFFAOYSA-N
XLogP3.46
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-methylphenyl)-4-[(4-methylphenyl)methyl]piperazine
CID 785695
1-(2-methylphenyl)-4-[(4-methylphenyl)methyl]piperazine;dihydrobromide
CID 142643740
1-[(4-methoxyphenyl)methyl]-4-(2-methylphenyl)piperazine
CID 791315
4-[[4-(2-methylphenyl)piperazin-1-yl]methyl]benzoic acid
CID 23964120
1-(2-methylphenyl)-4-[(4-pyrazol-1-ylphenyl)methyl]piperazine
CID 17496707
1-(2-methylphenyl)-4-[(4-phenylmethoxyphenyl)methyl]piperazine
CID 1376375
1,4,7,10-tetrakis[(4-fluorophenyl)methyl]-1,4,7,10-tetrazacyclododecane
CID 102293981
1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-(2-methylphenyl)piperazine
CID 4997131
1-(2,3-dimethylphenyl)-4-[(4-methylsulfanylphenyl)methyl]piperazine
CID 1377205
1-[(4-imidazol-1-ylphenyl)methyl]-4-(2-methylphenyl)piperazine
CID 112801173
1-[(4-ethylphenyl)methyl]-4-[(4-fluorophenyl)methyl]piperazine
CID 881940
[4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]methanone
CID 3300598

Frequently Asked Questions

What is the IUPAC name of 1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine?
The IUPAC name of 1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine (CID 1377218) is 1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine.
What is the SMILES notation for 1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine?
The canonical SMILES for 1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine is Cc1ccccc1N1CCN(Cc2ccc(F)cc2)CC1.
What is the InChIKey of 1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine?
The InChIKey is BYBZNLJGXMTDGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2/c1-15-4-2-3-5-18(15)21-12-10-20(11-13-21)14-16-6-8-17(19)9-7-16/h2-9H,10-14H2,1H3.
What are the key properties of 1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine?
1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine has a molecular weight of 284.38 g/mol, XLogP of 3.46, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-fluorophenyl)methyl]-4-(2-methylphenyl)piperazine is sourced from PubChem (CID 1377218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).